Vitas-M small molecule compound
ethyl 5-methyl-4-phenyl-2-({[4-(pyrimidin-2-yl)piperazin-1-yl]carbonothioyl}amino)thiophene-3-carboxylate
Catalog ID
STK455821
SMILES CCOC(=O)c1c(NC(=S)N2CCN(CC2)c2ncccn2)sc(c1c1ccccc1)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C23H25N5O2S2 MW 467.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N5O2S2/c1-3-30-21(29)19-18(17-8-5-4-6-9-17)16(2)32-20(19)26-23(31)28-14-12-27(13-15-28)22-24-10-7-11-25-22/h4-11H,3,12-15H2,1-2H3,(H,26,31)InChIKey
NCOGGWXAFOSUKD-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=S)N3CCN(CC3)C4=NC=CC=N4
ethyl5methyl4phenyl2(((4(pyrimidin2yl)piperazin1yl)carbonothioyl)amino)thiophene3carboxylate
ETHYL5METHYL4PHENYL2(((4PYRIMIDIN2YLPIPERAZINYL)THIOXOMETHYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL5METHYL4PHENYL2((4PYRIMIDIN2YLPIPERAZINE1CARBOTHIOYL)AMINO)THIOPHENE3CARBOXYLATE
InChI=1SC23H25N5O2S2c133021(29)1918(178546917)16(2)3220(19)2623(31)28141227(131528)2224107112522h411H31215H212H3(H2631)
MFCD04227673
ZINC000016346557
ZINC16346557
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